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Compound Detail

CHEMBL5924753

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COC(C)(C)c1cccc(-c2cc3nccc(N[C@@H]4C[C@H](COS(N)(=O)=O)[C@@H](O)[C@H]4O)n3n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5924753
Phase Preclinical
Structure Type MOL
InChI Key ODLWUPZLPZYPNN-NVGWVTIJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

491.6
MW (Da)
1.02
ALogP
10
HBA
4
HBD
161.3
PSA (Ų)
0.36
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H29N5O6S
MW 491.57
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine